CCCCOC(=O)C(C)Oc1cccc(Oc2ccc(CN(Cc3ccccc3)c3cccc([N+](=O)[O-])c3C)cc2)c1
SMILES: CCCCOC(=O)C(C)Oc1cccc(Oc2ccc(CN(Cc3ccccc3)c3cccc([N+](=O)[O-])c3C)cc2)c1

Molecular Processing

Molecular formula
C34H36N2O6
Molecular weight
568.67
Exact mass
568.2573
XLogP
8.01
TPSA
91.14
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
14
Heavy atoms
42
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.265
Molar refractivity
163.08

Supplementary Information

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